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Structure of beta-fructofuranosidase from schwanniomyces occidentalis complexed with sucrose

Analyse Structure of beta-fructofuranosidase from schwanniomyces occidentalis complexed… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6S1T
Type
protein
Length
1,024 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fructofuranosidase
EC
3.2.1.26
UniProt
E5D0X5
Ligands
NAG, GLC, FRU, BMA, ZN
Pockets
7 · best druggability 0.88

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BFructofuranosidase (EC 3.2.1.26)protein5124% helix, 50% strandE5D0X5

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 13 copies · chains A, B
  • GLC · alpha-D-glucopyranose · sugar · 2 copies · chains A, B
  • FRU · beta-D-fructofuranose · sugar · 2 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar · chains A
  • ZN · Zinc ion · metal · chains A, B
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

7 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110230.880.90142GLC, FRU
22650.600.7929EDO
32580.570.7832EDO
42920.540.7543empty
5910.340.7416empty

Interfaces

1 interface between chains.

  • A–B · 2123 Ų buried · 36 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 glycan (N-glycosylation).

Compared structures

  • 6S1T · Structure of beta-fructofuranosidase from Schwanniomyces occidentalis complexed with… · the same entry in another collection · chain A against A, TM-score 1.00

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